5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride

C8H16ClNO — CID 146102364

IUPAC5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride
SMILESCl.OCC1CCNC12CCC2
InChIInChI=1S/C8H15NO.ClH/c10-6-7-2-5-9-8(7)3-1-4-8;/h7,9-10H,1-6H2;1H
InChIKeyBLDMBAHZUUAKOM-UHFFFAOYSA-N
MW177.67 g/mol
LogP0.93
Rot. Bonds1

About 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride

5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride (PubChem CID 146102364) has the molecular formula C8H16ClNO and a molecular weight of 177.67 g/mol. Its IUPAC name is 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride.

Molecular Properties

Compound Name5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride
PubChem CID146102364
Molecular FormulaC8H16ClNO
Molecular Weight177.67 g/mol
Exact Mass177.09
IUPAC Name5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride
SMILESCl.OCC1CCNC12CCC2
InChIInChI=1S/C8H15NO.ClH/c10-6-7-2-5-9-8(7)3-1-4-8;/h7,9-10H,1-6H2;1H
InChIKeyBLDMBAHZUUAKOM-UHFFFAOYSA-N
XLogP0.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.67
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride?
The IUPAC name of 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride (CID 146102364) is 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride.
What is the SMILES notation for 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride?
The canonical SMILES for 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride is Cl.OCC1CCNC12CCC2.
What is the InChIKey of 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride?
The InChIKey is BLDMBAHZUUAKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.ClH/c10-6-7-2-5-9-8(7)3-1-4-8;/h7,9-10H,1-6H2;1H.
What are the key properties of 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride?
5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride has a molecular weight of 177.67 g/mol, XLogP of 0.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-azaspiro[3.4]octan-8-ylmethanol;hydrochloride is sourced from PubChem (CID 146102364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).